sodium 5-nitro-2-(2-propoxyethoxy)benzenesulfonate

Systemtic Name: sodium 5-nitro-2-(2-propoxyethoxy)benzenesulfonate Openeye Name: sodium 5-nitro-2-(2-propoxyethoxy)benzenesulfonate CAS Name: sodium 5-nitro-2-(2-propoxyethoxy)benzenesulfonate IUPAC Name: sodium 5-nitro-2-(2-propoxyethoxy)benzenesulfonate Traditional Name: sodium 5-nitro-2-(2-propoxyethoxy)besylate Formula: C11H14NNaO7S MolecularWeight: 327.28613

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCCOCCOC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H15NO7S.Na/c1-2-5-18-6-7-19-10-4-3-9(12(13)14)8-11(10)20(15,16)17;/h3-4,8H,2,5-7H2,1H3,(H,15,16,17);/q;+1/p-1